6-[4-(5-decylpyrimidin-2-yl)phenyl]carbonyloxy-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid

Systemtic Name: 6-[4-(5-decylpyrimidin-2-yl)phenyl]carbonyloxy-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid Openeye Name: 2-[4-(5-decylpyrimidin-2-yl)benzoyl]oxytetralin-6-carboxylic acid CAS Name: 6-[[4-(5-decyl-2-pyrimidinyl)phenyl]-oxomethoxy]-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid IUPAC Name: 6-[4-(5-decylpyrimidin-2-yl)benzoyl]oxy-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid Traditional Name: 2-[4-(5-decylpyrimidin-2-yl)benzoyl]oxytetralin-6-carboxylic acid Formula: C32H38N2O4 MolecularWeight: 514.65512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3CCC4=C(C3)C=CC(=C4)C(=O)O

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3CCC4=C(C3)C=CC(=C4)C(=O)O

InChI

InChI=1S/C32H38N2O4/c1-2-3-4-5-6-7-8-9-10-23-21-33-30(34-22-23)24-11-13-25(14-12-24)32(37)38-29-18-17-26-19-28(31(35)36)16-15-27(26)20-29/h11-16,19,21-22,29H,2-10,17-18,20H2,1H3,(H,35,36)